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pro vyhledávání: '"Luohua Liu"'
Publikováno v:
Modelling and Simulation in Engineering, Vol 2015 (2015)
Molecular dynamics simulations are necessary to perform very long integration times. In this paper, we discuss continuous finite element methods for molecular dynamics simulation problems. Our numerical results about AB diatomic molecular system and
Externí odkaz:
https://doaj.org/article/612362a6094541f9b4e54876f3af1b6f
Publikováno v:
Chemical Biology & Drug Design. 97:565-571
A series of indirubin derivatives hydrochloride were obtained using a convenient and mild method from indirubin. The newly synthesized compounds and their derivatives were characterized by 1 H NMR, 13 C NMR, and MS. Furthermore, we tested their IDO1
Publikováno v:
Electrochimica Acta. 370:137801
Heteroatoms doped nano-porous carbon materials possess well-designed porosity and also exhibit extremely advantages over high-performance electrodes for supercapacitors (SCs). Herein, we fabricate hierarchically porous boron-doped carbon material (B-
Publikováno v:
Modelling and Simulation in Engineering, Vol 2015 (2015)
Molecular dynamics simulations are necessary to perform very long integration times. In this paper, we discuss continuous finite element methods for molecular dynamics simulation problems. Our numerical results aboutABdiatomic molecular system andA2B